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CHEBI:57853 - hypotaurine zwitterion

Default Structure
ChEBI IDCHEBI:57853
ChEBI Namehypotaurine zwitterion
Stars
DefinitionZwitterionic form of hypotaurine arising from migration of a proton from the sulfonate group to the amino group; major species at pH 7.3.
Last Modified2 April 2019
DownloadsMolfile
FormulaC2H7NO2S
Net Charge0
Average Mass109.150
Monoisotopic Mass109.01975
SMILES[NH3+]CCS(=O)[O-]
InChIInChI=1S/C2H7NO2S/c3-1-2-6(4)5/h1-3H2,(H,4,5)
InChIKeyVVIUBCNYACGLLV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
hypotaurine zwitterion (CHEBI:57853) is a zwitterion (CHEBI:27369)
hypotaurine zwitterion (CHEBI:57853) is conjugate acid of hypotaurine(1−) (CHEBI:140741)
hypotaurine zwitterion (CHEBI:57853) is tautomer of hypotaurine (CHEBI:16668)
Incoming Relation(s)
hypotaurine(1−) (CHEBI:140741) is conjugate base of hypotaurine zwitterion (CHEBI:57853)
hypotaurine (CHEBI:16668) is tautomer of hypotaurine zwitterion (CHEBI:57853)
IUPAC Name 
2-azaniumylethanesulfinate
Synonyms  Source
2-ammonioethanesulfinateChEBI
2-azaniumylethane-1-sulfinateChEBI
2-mmonioethane-1-sulfinateChEBI
UniProt Name  Source
hypotaurineUniProt